Difference between revisions of "BENZENE-NO2"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-9536 RXN-9536] == * direction: ** LEFT-TO-RIGHT * common name: ** 3-oxo-meristoyl-[acyl-carrier...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] == * smiles: ** C1(=CC=C(C=C1)[N+]([O-])=O) * common name: ** nitroben...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-9536 RXN-9536] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZENE-NO2 BENZENE-NO2] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C1(=CC=C(C=C1)[N+]([O-])=O)
 
* common name:
 
* common name:
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** 3-oxo-meristoyl-[acyl-carrier protein] reductase
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** nitrobenzene
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** polyketide_synthase
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* inchi key:
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** 3-oxoacyl-(acyl-carrier-protein)
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** InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/2.3.1.86 EC-2.3.1.86]
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** 123.111   
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** [http://enzyme.expasy.org/EC/2.3.1.85 EC-2.3.1.85]
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** [http://enzyme.expasy.org/EC/1.1.1.100 EC-1.1.1.100]
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* Synonym(s):
 
* Synonym(s):
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** benzene-NO2
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** nitro-benzene
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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* [[RXN-3661]]
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** 1 [[NADPH]][c] '''+''' 1 [[PROTON]][c] '''+''' 1 [[3-oxo-myristoyl-ACPs]][c] '''=>''' 1 [[NADP]][c] '''+''' 1 [[R-3-hydroxymyristoyl-ACPs]][c]
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== Reaction(s) known to produce the compound ==
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 NADPH[c] '''+''' 1 H+[c] '''+''' 1 a 3-oxo-myristoyl-[acp][c] '''=>''' 1 NADP+[c] '''+''' 1 a (3R)-3-hydroxymyristoyl-[acp][c]
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[Tiso_gene_13394]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_10415]]
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** [[pantograph]]-[[synechocystis]]
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* [[Tiso_gene_13083]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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** [[pantograph]]-[[synechocystis]]
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** [[pantograph]]-[[esiliculosus]]
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* [[Tiso_gene_10876]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_500]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_624]]
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** [[pantograph]]-[[synechocystis]]
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* [[Tiso_gene_16579]]
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** [[pantograph]]-[[synechocystis]]
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* [[Tiso_gene_136]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_9885]]
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_135]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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== Pathways  ==
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* [[PWY-5971]], palmitate biosynthesis II (bacteria and plants): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5971 PWY-5971]
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** '''31''' reactions found over '''31''' reactions in the full pathway
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* [[PWY-5994]], palmitate biosynthesis I (animals and fungi): [http://metacyc.org/META/NEW-IMAGE?object=PWY-5994 PWY-5994]
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** '''31''' reactions found over '''31''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[orthology]]
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** Source: [[orthology-synechocystis]]
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*** Tool: [[pantograph]]
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** Source: [[orthology-esiliculosus]]
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*** Tool: [[pantograph]]
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* Category: [[manual]]
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** Source: [[manual-primary_network]]
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* Category: [[annotation]]
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** Source: [[annotation-experimental_annotation]]
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*** Tool: [[pathwaytools]]
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** Source: [[annotation-in-silico_annotation]]
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*** Tool: [[pathwaytools]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* CAS : 98-95-3
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{{#set: common name=3-oxo-meristoyl-[acyl-carrier protein] reductase}}
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* PUBCHEM:
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{{#set: common name=polyketide_synthase}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7416 7416]
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{{#set: common name=3-oxoacyl-(acyl-carrier-protein)}}
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* HMDB : HMDB41950
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{{#set: ec number=EC-2.3.1.86}}
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* LIGAND-CPD:
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{{#set: ec number=EC-2.3.1.85}}
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** [http://www.genome.jp/dbget-bin/www_bget?C06813 C06813]
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{{#set: ec number=EC-1.1.1.100}}
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* CHEMSPIDER:
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{{#set: gene associated=Tiso_gene_13394|Tiso_gene_10415|Tiso_gene_13083|Tiso_gene_10876|Tiso_gene_500|Tiso_gene_624|Tiso_gene_16579|Tiso_gene_136|Tiso_gene_9885|Tiso_gene_135}}
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** [http://www.chemspider.com/Chemical-Structure.7138.html 7138]
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{{#set: in pathway=PWY-5971|PWY-5994}}
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* CHEBI:
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{{#set: reconstruction category=orthology|manual|annotation}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27798 27798]
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{{#set: reconstruction source=annotation-experimental_annotation|manual-primary_network|annotation-in-silico_annotation|orthology-synechocystis|orthology-esiliculosus}}
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{{#set: smiles=C1(=CC=C(C=C1)[N+]([O-])=O)}}
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{{#set: reconstruction tool=pantograph|pathwaytools}}
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{{#set: common name=nitrobenzene}}
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{{#set: inchi key=InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N}}
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{{#set: molecular weight=123.111    }}
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{{#set: common name=benzene-NO2|nitro-benzene}}
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{{#set: consumed by=RXN-3661}}

Latest revision as of 21:22, 21 March 2018

Metabolite BENZENE-NO2

  • smiles:
    • C1(=CC=C(C=C1)[N+]([O-])=O)
  • common name:
    • nitrobenzene
  • inchi key:
    • InChIKey=LQNUZADURLCDLV-UHFFFAOYSA-N
  • molecular weight:
    • 123.111
  • Synonym(s):
    • benzene-NO2
    • nitro-benzene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 98-95-3
  • PUBCHEM:
  • HMDB : HMDB41950
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
"C1(=CC=C(C=C1)[N+]([O-])=O)" cannot be used as a page name in this wiki.



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